Journal articles on the topic 'Crystal14'
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Dovesi, Roberto, Roberto Orlando, Alessandro Erba, Claudio M. Zicovich-Wilson, Bartolomeo Civalleri, Silvia Casassa, Lorenzo Maschio, et al. "CRYSTAL14 : A program for the ab initio investigation of crystalline solids." International Journal of Quantum Chemistry 114, no. 19 (March 11, 2014): 1287–317. http://dx.doi.org/10.1002/qua.24658.
Full textNoël, Yves, Marco De La Pierre, Claudio M. Zicovich-Wilson, Roberto Orlando, and Roberto Dovesi. "Structural, electronic and energetic properties of giant icosahedral fullerenes up to C6000: insights from an ab initio hybrid DFT study." Phys. Chem. Chem. Phys. 16, no. 26 (2014): 13390–401. http://dx.doi.org/10.1039/c4cp01442a.
Full textЧернышев, В. А., В. С. Рюмшин, and П. А. Агзамова. "Структура и динамика решетки MeF-=SUB=-2-=/SUB=- (Me=Ca, Sr, Ba, Pb) в кубической и орто-фазах: ab initio расчет." Физика твердого тела 61, no. 1 (2019): 137. http://dx.doi.org/10.21883/ftt.2019.01.46904.188.
Full textReid, Joel W., James A. Kaduk, and Jeremy A. Olson. "The crystal structure of Na(NH4)Mo3O10·H2O." Powder Diffraction 32, no. 2 (June 2017): 140–47. http://dx.doi.org/10.1017/s0885715617000380.
Full textReid, Joel W., James A. Kaduk, and Martin Vickers. "The crystal structure of trandolapril, C24H34N2O5: an example of the utility of raw data deposition in the powder diffraction file." Powder Diffraction 31, no. 3 (June 14, 2016): 205–10. http://dx.doi.org/10.1017/s0885715616000294.
Full textReid, Joel W., James A. Kaduk, and Lidia Matei. "The crystal structure of MoO2(O2)H2O." Powder Diffraction 33, no. 1 (February 14, 2018): 49–54. http://dx.doi.org/10.1017/s0885715618000118.
Full textSaleev, Vladimir, and Alexandra Shipilova. "First-principles calculations of LiNbO3 optical properties: From far-infrared to ultraviolet." Modern Physics Letters B 32, no. 05 (February 20, 2018): 1850063. http://dx.doi.org/10.1142/s021798491850063x.
Full textSuzuki, Kosuke, Ayumu Terasaka, Tomoya Abe, and Hiroshi Sakurai. "Modification of Electronic Structures with Lithium Intercalation in LixMn2O4 (x = 0 and 1) Studied by CRYSTAL14 Calculation Code." Key Engineering Materials 790 (November 2018): 15–19. http://dx.doi.org/10.4028/www.scientific.net/kem.790.15.
Full textReid, Joel W., James A. Kaduk, and Lidia Matei. "The crystal structure of MoO2(O2)(H2O)·H2O." Powder Diffraction 34, no. 1 (February 7, 2019): 44–49. http://dx.doi.org/10.1017/s0885715619000095.
Full textMesquita, Weber D., Maria R. C. Santos, Mario G. Junior, Sérgio H. B. S. Leal, José W. M. Espinosa, Elson Longo, and Maria F. C. Gurgel. "Efeito do Substituinte Sr na Transição de Fase do PT: Correlação Teórica e Experimental das Propriedades Eletrônicas e Estruturais." Revista Processos Químicos 13, no. 26 (March 9, 2020): 73–80. http://dx.doi.org/10.19142/rpq.v13i26.542.
Full textSaleev, Vladimir, and Alexandra Shipilova. "Ab initio study of optical and bulk properties of cesium lead halide perovskite solid solutions." Modern Physics Letters B 33, no. 31 (November 10, 2019): 1950386. http://dx.doi.org/10.1142/s021798491950386x.
Full textLei, Lin. "Bowlic Liquid Crystalsl." Molecular Crystals and Liquid Crystals 146, no. 1 (May 1987): 41–54. http://dx.doi.org/10.1080/00268948708071801.
Full textFrancis, Carl A. "Gold CrystalsA Primer." Rocks & Minerals 79, no. 1 (February 2004): 24–29. http://dx.doi.org/10.1080/00357529.2004.9925671.
Full textNelson, J. "Growth-deviation model to understand the perceived variety of falling snow." Atmospheric Chemistry and Physics Discussions 8, no. 2 (March 4, 2008): 4407–37. http://dx.doi.org/10.5194/acpd-8-4407-2008.
Full textTipaldi, C. F., and J. Gabrusenoks. "Lattice Dynamics Calculations for Mg1-XZnxO Solid Solutions." Latvian Journal of Physics and Technical Sciences 59, no. 2 (April 1, 2022): 3–11. http://dx.doi.org/10.2478/lpts-2022-0007.
Full textKnepp, T. N., T. L. Renkens, and P. B. Shepson. "Measurement of acidic ions and their qualitative effects on snow crystal morphology and the quasi-liquid layer." Atmospheric Chemistry and Physics Discussions 9, no. 1 (January 9, 2009): 735–66. http://dx.doi.org/10.5194/acpd-9-735-2009.
Full textJanulis, Eugene P., James C. Novack, George A. Papapolymerou, Miguel Tristani-Kendra, and William A. Huffman. "Fluorinated ferroelectric liquid crystals1." Ferroelectrics 85, no. 1 (September 1988): 375–84. http://dx.doi.org/10.1080/00150198808007670.
Full textJIN, D. Z., and D. H. E. DUBIN. "Two-Dimensional Vortex Crystalsa." Annals of the New York Academy of Sciences 848, no. 1 LONG-RANGE CO (May 1998): 18–25. http://dx.doi.org/10.1111/j.1749-6632.1998.tb08954.x.
Full textMorozov, M. M., A. I. Potekaev, A. A. Klopotov, T. N. Markova, and V. D. Klopotov. "ALLOYS ON THE BASIS OF PALLADIUM. CRYSTALLO-GEOMETRICAL AND CRYSTALLO-CHEMICAL PARAMETERS." Izvestiya Visshikh Uchebnykh Zavedenii. Chernaya Metallurgiya = Izvestiya. Ferrous Metallurgy 57, no. 12 (April 1, 2015): 42. http://dx.doi.org/10.17073/0368-0797-2014-12-42-49.
Full textZhang, Fei Hu, Shao Long Guo, Yong Zhang, and Dian Rong Luan. "Research on the Material Removal Mechanism in Deliquescent Polishing of KDP Crystals." Key Engineering Materials 416 (September 2009): 487–91. http://dx.doi.org/10.4028/www.scientific.net/kem.416.487.
Full textKnepp, T. N., T. L. Renkens, and P. B. Shepson. "Gas phase acetic acid and its qualitative effects on snow crystal morphology and the quasi-liquid layer." Atmospheric Chemistry and Physics 9, no. 20 (October 16, 2009): 7679–90. http://dx.doi.org/10.5194/acp-9-7679-2009.
Full textSenthamizhan, A., K. Sambathkumar, S. Nithiyanantham, and A. A. Alagiriswamy. "Electrical, Optical, Structural Properties with Some Physico-Mechanical of Pure and La3+ Doped L-Alanine Acetate Single Crystals." Sensor Letters 18, no. 12 (December 1, 2020): 894–99. http://dx.doi.org/10.1166/sl.2020.4307.
Full textMcPherson, Alexander. "pH and Redox Induced Color Changes in Protein Crystals Suffused with Dyes." Crystals 9, no. 3 (March 1, 2019): 126. http://dx.doi.org/10.3390/cryst9030126.
Full textGunter, Mickey E., and F. Donald Bloss. "The spindle stage: A powerful optical tool." Proceedings, annual meeting, Electron Microscopy Society of America 46 (1988): 52–53. http://dx.doi.org/10.1017/s0424820100102341.
Full textWang, Zhifeng, Yuquan Gan, Qianqian Du, Shuhong Li, Yunlong Liu, and Wenjun Wang. "Morphology-Dependent Optoelectronic Properties of Pentacene Nanoribbon and Nanosheet Crystallite." Materials 16, no. 2 (January 6, 2023): 557. http://dx.doi.org/10.3390/ma16020557.
Full textZhong, Z., M. Hasnah, A. Broadbent, E. Dooryhee, and M. Lucas. "Phase-space matching between bent Laue and flat Bragg crystals." Journal of Synchrotron Radiation 26, no. 6 (October 23, 2019): 1917–23. http://dx.doi.org/10.1107/s1600577519010774.
Full textDokou, Christina. "Londino-lstanbul by Crystalli Glyniadaki." World Literature Today 85, no. 2 (2011): 71–72. http://dx.doi.org/10.1353/wlt.2011.0149.
Full textSchmidt, Tracy Smith. "The crystal's in the mail..." Nature 423, no. 6942 (June 2003): 799–800. http://dx.doi.org/10.1038/423799a.
Full textMueck, Leonie. "Imagine a crystal's inner life." Nature 511, S7509 (July 17, 2014): 5. http://dx.doi.org/10.1038/nature13349.
Full textPraefcke, Klaus, Dirk Blunk, and Joachim Hempel. "News on Inositol Liquid Crystals1." Molecular Crystals and Liquid Crystals Science and Technology. Section A. Molecular Crystals and Liquid Crystals 243, no. 1 (March 1994): 323–52. http://dx.doi.org/10.1080/10587259408037774.
Full textMarei, Ahmed Hassan, and Isao Furuta. "Crystallo-integration in dental implantation." Oral Surgery, Oral Medicine, Oral Pathology 78, no. 2 (August 1994): 136. http://dx.doi.org/10.1016/0030-4220(94)90131-7.
Full textMartínez-González, José, Javier Navarro-Ruiz, and Albert Rimola. "Multiscale Computational Simulation of Amorphous Silicates’ Structural, Dielectric, and Vibrational Spectroscopic Properties." Minerals 8, no. 8 (August 15, 2018): 353. http://dx.doi.org/10.3390/min8080353.
Full textPolino, M., H. S. Rho, M. P. Pina, R. Mallada, A. L. Carvalho, M. J. Romão, Isabel Coelhoso, J. G. E. Gardeniers, J. G. Crespo, and Carla A. M. Portugal. "Protein Crystallization in a Microfluidic Contactor with Nafion®117 Membranes." Membranes 11, no. 8 (July 21, 2021): 549. http://dx.doi.org/10.3390/membranes11080549.
Full textMatko, Vojko, and Miro Milanovič. "Detection Principles of Temperature Compensated Oscillators with Reactance Influence on Piezoelectric Resonator." Sensors 20, no. 3 (February 1, 2020): 802. http://dx.doi.org/10.3390/s20030802.
Full textQin, L. C. "HREM of electron-irradiated silicas." Proceedings, annual meeting, Electron Microscopy Society of America 51 (August 1, 1993): 1102–3. http://dx.doi.org/10.1017/s0424820100151349.
Full textHidayathullah, A. M., R. S. Samuel, V. Chithambaram, R. Raja, and S. Janarthanan. "Investigations on the synthesis and growth and structural, spectral, optical, mechanical and thermal properties of non-linear optical single crystals of Bis-L-Seriniumoxalate Dihydrate (BLSOD)." Journal of Ovonic Research 19, no. 1 (January 2023): 43–52. http://dx.doi.org/10.15251/jor.2023.191.43.
Full textBulutoglu, Pelin Su, Conor Parks, Nandkishor K. Nere, Shailendra Bordawekar, and Doraiswami Ramkrishna. "Exploring New Crystal Structures of Glycine via Electric Field-Induced Structural Transformations with Molecular Dynamics Simulations." Processes 7, no. 5 (May 8, 2019): 268. http://dx.doi.org/10.3390/pr7050268.
Full textBaker, Oliver. "Innovative Crystal's Got Plenty O' Nuthin'." Science News 156, no. 21 (November 20, 1999): 327. http://dx.doi.org/10.2307/4012011.
Full textDorenbos, P., E. Bougrine, J. T. M. De Haas, C. W. E. Van Eijk, and M. V. Korzhik. "Scintillation properties of GdAlO3:Ce crystals1." Radiation Effects and Defects in Solids 135, no. 1-4 (December 1995): 321–23. http://dx.doi.org/10.1080/10420159508229859.
Full textDorenbos, P., M. Marsman, C. W. E. Van Eijk, M. V. Korzhik, and B. I. Mlnkov. "Scintillation properties of Y2SiO5:Pr crystals1." Radiation Effects and Defects in Solids 135, no. 1-4 (December 1995): 325–28. http://dx.doi.org/10.1080/10420159508229860.
Full textSunandana, C. S. "A crystallo-chemical approach to superionics." Journal of Physics and Chemistry of Solids 58, no. 9 (September 1997): 1359–65. http://dx.doi.org/10.1016/s0022-3697(97)00027-9.
Full textPraefcke, K., B. Kohne, B. Gündogan, D. Singer, D. Demus, S. Diele, G. Pelzl, and U. Bakowsky. "News on Nematic-Biaxial Liquid Crystals1." Molecular Crystals and Liquid Crystals 198, no. 1 (April 1991): 393–405. http://dx.doi.org/10.1080/00268949108033415.
Full textOnaka, Jessica, Daisuke Koyama, Yuma Kuroda, Akira Emoto, and Mami Matsukawa. "Optical evaluation of a double-layered ultrasound liquid crystal lens." Journal of Applied Physics 131, no. 19 (May 21, 2022): 193103. http://dx.doi.org/10.1063/5.0091093.
Full textTian, Ruifeng, Mingyan Pan, Lu Zhang, and Hongji Qi. "Crystal growth and spectral properties of (Yb0.15Lu0.85xY0.85-0.85x)3Al5O12 single crystals." Chinese Optics Letters 20, no. 12 (2022): 121601. http://dx.doi.org/10.3788/col202220.121601.
Full textGatta, G. D., N. Rotiroti, and M. Zucali. "Plastic deformations in kyanites by tectonometamorphic processes: a single-crystal X-ray diffraction study." Mineralogical Magazine 73, no. 3 (June 2009): 359–71. http://dx.doi.org/10.1180/minmag.2009.073.3.359.
Full textZakgeim, Dmitrii, Dmitrii Bauman, Dmitrii Panov, Vladislav Spiridonov, Arina Kremleva, Andrei Smirnov, Maxim Odnoblyudov, Alexey Romanov, and Vladislav Bougrov. "Growing of bulk β-(Al x Ga1−x )2O3 crystals from the melt by Czochralski method and investigation of their structural and optical properties." Applied Physics Express 15, no. 2 (January 17, 2022): 025501. http://dx.doi.org/10.35848/1882-0786/ac44ca.
Full textYi, Chengqi. "Probing enzyme-mediated oxidation reactions in crystallo." Pure and Applied Chemistry 83, no. 12 (October 31, 2011): 2199–212. http://dx.doi.org/10.1351/pac-con-11-08-10.
Full textVaradachari, Chandrika, Tarit Chattopadhyay, and Kunal Ghosh. "The crystallo-chemistry of oxide-humus complexes." Soil Research 38, no. 4 (2000): 789. http://dx.doi.org/10.1071/sr99053.
Full textChen, Fanrong, Peter C. Burns, and Rodney C. Ewing. "79Se: geochemical and crystallo-chemical retardation mechanisms." Journal of Nuclear Materials 275, no. 1 (October 1999): 81–94. http://dx.doi.org/10.1016/s0022-3115(99)00105-1.
Full textTowler, M. J., H. G. Walton, and I. W. Stewart. "Important Physical Properties of Smectic Liquid Crystals1." Liquid Crystals Today 8, no. 1 (March 1998): 5–9. http://dx.doi.org/10.1080/13583149808047692.
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